N-ethenyl-N'-prop-1-enylethanimidamide

C7H12N2 — CID 123875249

IUPACN-ethenyl-N'-prop-1-enylethanimidamide
SMILESC=CN/C(C)=N/C=CC
InChIInChI=1S/C7H12N2/c1-4-6-9-7(3)8-5-2/h4-6H,2H2,1,3H3,(H,8,9)
InChIKeyRJAAREFIQUYIQU-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.67
Rot. Bonds2

About N-ethenyl-N'-prop-1-enylethanimidamide

N-ethenyl-N'-prop-1-enylethanimidamide (PubChem CID 123875249) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is N-ethenyl-N'-prop-1-enylethanimidamide.

Molecular Properties

Compound NameN-ethenyl-N'-prop-1-enylethanimidamide
PubChem CID123875249
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC NameN-ethenyl-N'-prop-1-enylethanimidamide
SMILESC=CN/C(C)=N/C=CC
InChIInChI=1S/C7H12N2/c1-4-6-9-7(3)8-5-2/h4-6H,2H2,1,3H3,(H,8,9)
InChIKeyRJAAREFIQUYIQU-UHFFFAOYSA-N
XLogP1.67
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2,2,2-trifluoro-N'-methyl-N-[(Z)-prop-1-enyl]ethanimidamide
CID 144826412
N-[(1E)-2-fluorobuta-1,3-dienyl]-N'-methylethanimidamide
CID 156349099
4-fluoro-2-methyl-1H-pyrimidin-4-amine
CID 176199382
(4E,8E)-7-fluoro-2-methyl-6,7-dihydro-1H-1,3-diazonine
CID 144356783
N'-methyl-N-prop-2-enylethanimidamide
CID 12683067
2-Methyl-1,4-dihydropyrimidine
CID 13432429
2-methyl-1H-imidazol-1-ium
CID 19047642
carbanide;N-methyl-2H-pyrimidin-2-id-4-amine;vanadium(2+)
CID 20644795
1,2,3-trimethyl-1H-imidazole-1,3-diium
CID 20652611
N'-ethyl-N-prop-1-enylmethanimidamide
CID 54520223
2-Methyl-1H-1,3-diazepine
CID 56992381
2-ethenyl-1H-1,3-diazepine
CID 56992451

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-prop-1-enylethanimidamide?
The IUPAC name of N-ethenyl-N'-prop-1-enylethanimidamide (CID 123875249) is N-ethenyl-N'-prop-1-enylethanimidamide.
What is the SMILES notation for N-ethenyl-N'-prop-1-enylethanimidamide?
The canonical SMILES for N-ethenyl-N'-prop-1-enylethanimidamide is C=CN/C(C)=N/C=CC.
What is the InChIKey of N-ethenyl-N'-prop-1-enylethanimidamide?
The InChIKey is RJAAREFIQUYIQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-4-6-9-7(3)8-5-2/h4-6H,2H2,1,3H3,(H,8,9).
What are the key properties of N-ethenyl-N'-prop-1-enylethanimidamide?
N-ethenyl-N'-prop-1-enylethanimidamide has a molecular weight of 124.19 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-prop-1-enylethanimidamide is sourced from PubChem (CID 123875249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).